UCSF

ZINC08438534

Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 35 No

Other Names:

MFCD03700355

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.00 -2.69 -53.8 3 9 1 109 483.541 9
Mid Mid (pH 6-8) 1.42 -2.77 -64.36 2 9 1 106 483.541 9

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )